N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide

C11H23NO3S — CID 62351553

IUPACN-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide
SMILESCOCCN(C(C)C1CC1)S(=O)(=O)C(C)C
InChIInChI=1S/C11H23NO3S/c1-9(2)16(13,14)12(7-8-15-4)10(3)11-5-6-11/h9-11H,5-8H2,1-4H3
InChIKeyIRPOXSKKCUMSIO-UHFFFAOYSA-N
MW249.38 g/mol
LogP1.47
Rot. Bonds7

About N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide

N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide (PubChem CID 62351553) has the molecular formula C11H23NO3S and a molecular weight of 249.38 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide
PubChem CID62351553
Molecular FormulaC11H23NO3S
Molecular Weight249.38 g/mol
Exact Mass249.14
IUPAC NameN-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide
SMILESCOCCN(C(C)C1CC1)S(=O)(=O)C(C)C
InChIInChI=1S/C11H23NO3S/c1-9(2)16(13,14)12(7-8-15-4)10(3)11-5-6-11/h9-11H,5-8H2,1-4H3
InChIKeyIRPOXSKKCUMSIO-UHFFFAOYSA-N
XLogP1.47
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide?
The IUPAC name of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide (CID 62351553) is N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide.
What is the SMILES notation for N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide?
The canonical SMILES for N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide is COCCN(C(C)C1CC1)S(=O)(=O)C(C)C.
What is the InChIKey of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide?
The InChIKey is IRPOXSKKCUMSIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3S/c1-9(2)16(13,14)12(7-8-15-4)10(3)11-5-6-11/h9-11H,5-8H2,1-4H3.
What are the key properties of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide?
N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide has a molecular weight of 249.38 g/mol, XLogP of 1.47, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-N-(2-methoxyethyl)propane-2-sulfonamide is sourced from PubChem (CID 62351553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).